SCHEMBL2137198

SCHEMBL2137198

COC(=O)c1nc(Cl)cc(NCc2ccccc2C)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.47
SRC P12931 1/20 0.47
BRD4 O60885 2/20 0.46
KAT2B Q92831 1/20 0.46
CD38 P28907 2/20 0.44
MAPT P10636 3/20 0.44
KCNN3 Q9UGI6 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HSP90AA1 P07900 2/20 0.42
HSP90B1 P14625 1/20 0.42
KDM4E B2RXH2 2/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
MEN1 O00255 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14700195 0.91 ABL1 (0.47) ABL1SRCBRD4KAT2BCD38
SCHEMBL2136399 0.88 ABL1 (0.46) ABL1SRCBRD4KAT2BCD38
SCHEMBL2137639 0.87 BCHE (0.49) ABL1SRCMAPTKCNN3NPSR1
SCHEMBL2134833 0.87 HSP90AA1 (0.43) MAPTCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL2140565 0.87 ABL1 (0.48) ABL1SRCCD38MAPTHSP90AA1
SCHEMBL2135378 0.85 ABL1 (0.44) ABL1SRCBRD4KAT2BCD38
SCHEMBL2139093 0.84 ABL1 (0.51) ABL1SRCCD38CYP3A4HTT
SCHEMBL2137266 0.84 HTT (0.51) MAPTCYP3A4CYP2D6CYP2C19HTT
SCHEMBL2135021 0.84 CA1 (0.47) BRD4KAT2BMAPTCYP1A2CYP3A4
SCHEMBL2136669 0.83 ADORA2A (0.43) HSP90AA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2445884-B1 4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA LTD (GB) 2013-02-13 EP disclosed
US-20120100990-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-04-26 US disclosed
US-20120100990-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-04-26 US disclosed
US-20120100990-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-04-26 US disclosed
WO-2010149956-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES SYNGENTA LIMITED (GB) 2010-12-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120100990-A1 4 -AMINOPICOLINATES AND THEIR USE AS HERBICIDES DDT, DAO, NPM1 ABL1 532/4885SRC 1958/4885BRD4 1776/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.